Citation: JIANG Li-Lin. Influence of Photoinduced Electron Transfer on the Ground-State Molecular Structure of Rhodamine 6G Determined by Nonresonance Raman Spectroscopy[J]. Acta Physico-Chimica Sinica, ;2014, 30(11): 1987-1992. doi: 10.3866/PKU.WHXB201409252 shu

Influence of Photoinduced Electron Transfer on the Ground-State Molecular Structure of Rhodamine 6G Determined by Nonresonance Raman Spectroscopy

JIANG Li-Lin

1.
Department of Mechanics and Electronics Engineering, Hezhou University, Hezhou 542899, Guangxi Zhuang Autonomous Region, P. R. China

Received Date: 16 August 2014
Available Online: 25 September 2014
Fund Project: 国家自然科学基金(21003033, 21203047) (21003033, 21203047) 广西自然科学面上基金(2014GXNSFAA118019) (2014GXNSFAA118019) 广西教育厅科研重点基金(ZD2014127) (ZD2014127)贺州学院博士科研启动基金(HZUBS201401)资助项目 (HZUBS201401)

Changes of the ground-state molecular structure of rhodamine 6G (Rh6G⁺) in pure electron donor solvent N,N-diethylaniline (DEA) were investigated by nonresonance Raman spectroscopy and quantum chemical calculations to help understand photoinduced intermolecular electron transfer (PIET) in this system. All of the vibrational modes coupled to PIET were determined and assigned. The results indicate that the most prominent vibrational mode at 675 cm^-1, corresponding to the in-plane bending of the xanthene ring, strongly contributes to PIET. Compared with the C―C stretching mode, the C=C stretching vibration of the chromophore aromatic ring of the Rh6G/DEA⁺ charge-transfer complex is more sensitive to PIET. This work provides new insight for designing molecular structures or solvent environments with desirable electron transfer properties for use in photovoltaic devices.
- Ground-state molecular structure,
- Rhodamine 6G,
- Nonresonance Raman spectroscopy,
- Quantum chemical calculation,
- Photoinduced intermolecular electron transfer
1. [1]
  
  (1) Marcus, R. A.; Sutin, N. B. Biochim. Biophys. Acta 1985, 811, 265. doi: 10.1016/0304-4173(85)90014-X
2. [2]
  (2) Maroncelli, M.; MacInnis, J.; Fleming, G. R. Science 1989, 243, 1674. doi: 10.1126/science.243.4899.1674
3. [3]
  (3) Andrews, D. P.; McFadyen, G. G.; Beddard, G. S. Chem. Phys. Lett. 1998, 293, 343. doi: 10.1016/S0009-2614(98)00793-3
4. [4]
  (4) Newton, M. D.; Sutin, N. Anuu. Rev. Phys. Chem. 1984, 35, 437. doi: 10.1146/annurev.pc.35.100184.002253
5. [5]
  (5) Okada, A.; Chernyak, V.; Mukamel, S. J. Phys. Chem. A 1998, 102, 1241.(6) Marcus, R. A. J. Chem. Phys. 1956, 24, 966. doi: 10.1063/1.1742723
6. [6]
  (7) Bixon, M.; Jortner, J. J. Chem. Phys. 1986, 90, 3795. doi: 10.1021/100407a055
7. [7]
  (8) Marcus, R. A. Annu. Rev. Phys. Chem. 1964, 15, 155. doi: 10.1146/annurev.pc.15.100164.001103
8. [8]
  (9) Fleming, G. R.; Martin, J. L.; Breton, J. Nature 1998, 333, 190.
9. [9]
  (10) Frontiera, R. R.; Mathies, R. A. Laser Photonics Rev. 2011, 5, 102. doi: 10.1002/lpor.v5.1
10. [10]
  (11) Frontiera, R. R.; Dasgupta, J.; Mathies, R. A. J. Am. Chem. Soc. 2009, 131, 15630. doi: 10.1021/ja907188b
11. [11]
  (12) Kulinowski, K.; uld, I. R.; Myers, A. B. J. Phys. Chem. 1995, 99, 9017. doi: 10.1021/j100022a012
12. [12]
  (13) Phillips, D. L.; uld, I. R.; Verhoeven, J.W.; Tittelbach- Helmrich, D.; Myers, A. B. Chem. Phys. Lett. 1996, 258, 87. doi: 10.1016/0009-2614(96)00621-5
13. [13]
  (14) Myers, A. B. Chem. Rev. 1996, 96, 911. doi: 10.1021/cr950249c
14. [14]
  (15) Kelley, A. M. J. Phys. Chem. A 1999, 103, 6891.
15. [15]
  (16) Mchale, J. L. Accounts Chem. Res. 2001, 34, 265. doi: 10.1021/ar000007l
16. [16]
  (17) Shoute, L. C. T.; Loppnow, G. R. J. Chem. Phys. 2002, 117, 842. doi: 10.1063/1.1483848
17. [17]
  (18) Doom, S. K.; Hupp, J. T. J. Am. Chem. Soc. 1989, 111, 4704. doi: 10.1021/ja00195a025
18. [18]
  (19) Dasgupta, J.; Frontiera, R. R.; Taylor, K. C.; Lagarias, J. C.; Mathies, R. A. Proc. Natl. Acad. Sci. U. S. A. 2009, 106, 1784. doi: 10.1073/pnas.0812056106
19. [19]
  (20) Shim, S.; Stuart, C. M.; Mathies, R. A. ChemPhysChem 2008, 9, 697. doi: 10.1002/cphc.v9:5
20. [20]
  (21) Freudiger, C.W.; Min,W.; Saar, B. G.; Lu, S.; Holtom, G. R.; He, C.; Tsai, J. C.; Kang, J. X.; Xie, X. S. Science 2008, 322, 1857. doi: 10.1126/science.1165758
21. [21]
  (22) Mukamel, S. Annu. Rev. Phys. Chem. 2000, 51, 691. doi: 10.1146/annurev.physchem.51.1.691
22. [22]
  (23) Dsouza, R. N.; Pischel, U.; Nau,W. M. Chem. Rev. 2011, 111, 7941. doi: 10.1021/cr200213s
23. [23]
  (24) Birtwell, S.; Morgan, H. Integr. Biol. 2009, 1, 345. doi: 10.1039/b905502a
24. [24]
  (25) Berezin, M.; Achilefu, S. Chem. Rev. 2010, 110, 2641. doi: 10.1021/cr900343z
25. [25]
  (26) Borisov, S.;Wolfbeis, O. Chem. Rev. 2008, 108, 423. doi: 10.1021/cr068105t
26. [26]
  (27) Savarese, M.; Aliberti, A.; Santo, I. D.; Battista, E.; Causa, F.; Netti, P. A.; Rega, N. J. Phys. Chem. A 2012, 116, 7491. doi: 10.1021/jp3021485
27. [27]
  (28) Nie, S. M.; Emory, S. R. Science 1997, 275, 1102.
28. [28]
  (29) Qiu, X.; Li, X.; Niu, K.; Lee, S.Y. J. Raman Spectrosc. 2011, 42, 563. doi: 10.1002/jrs.v42.4
29. [29]
  (30) Hildebrandt, P.; Stockburger, M. J. Phys. Chem. 1984, 88, 5935. doi: 10.1021/j150668a038
30. [30]
  (31) Niu, K.; Lee, S.Y. J. Chem. Phys. 2012, 136, 064504. doi: 10.1063/1.3682470
31. [31]
  (32) Michaels, A. M.; Nirmal, M.; Brus, L. E. J. Am. Chem. Soc. 1999, 121, 9932. doi: 10.1021/ja992128q
32. [32]
  (33) Guthmuller, J.; Champagne, B. ChemPhysChem 2008, 9, 1667. doi: 10.1002/cphc.v9:12
33. [33]
  (34) Vosgröne, T.; Meixner, A. J. J. Lumin. 2004, 107, 13 doi: 10.1016/j.jlumin.2003.12.041
34. [34]
  (35) Frisch, M. J.; Trucks, G.W.; Schlegel, H. B.; et al. Gaussian 03, Revision E.01; Gaussian Inc.:Wallingford, CT, 2004.
35. [35]
  (36) Scott, A. P.; Radom, L. J. Phys. Chem. 1996, 100, 16502. doi: 10.1021/jp960976r
36. [36]
  (37) Nicolet, O.; Banerji, N.; Pagès, S.; Vauthey, E. J. Phys. Chem. A 2005, 109, 8236. doi: 10.1021/jp0532216
37. [37]
  (38) Saik, V. O.; un, A. A.; Fayer, M. D. J. Chem. Phys. 2004, 120, 9601. doi: 10.1063/1.1712826
38. [38]
  (39) Xu, Q. H.; Scholes, G. D.;Yang, M.; Fleming, G. R. J. Phys. Chem. A 1999, 103, 10348.
39. [39]
  (40) Watanabe, H.; Hayazawa, N.; Inouye,Y.; Kawata, S. J. Phys. Chem. B 2005, 109, 5012. doi: 10.1021/jp045771u
40. [40]
  (41) Pan, D.; Hu, D.; Lu, H. P. J. Phys. Chem. B 2005, 109, 16390. doi: 10.1021/jp058043v
41. [41]
  (42) Huo, M. M.; Liu,W. L.; Zheng, Z. R.; Zhang,W.; Li, A. H.; Xu, D. P. Molecules 2011, 16, 1973. doi: 10.3390/molecules16031973
42. [42]
  (43) Jiang, L. L.; Liu,W. L.; Song,Y. F.; He, X.;Wang,Y.;Wang, C.; Wu, H. L.;Yang, F.;Yang,Y. Q. Chem. Phys. 2014, 429, 12. doi: 10.1016/j.chemphys.2013.11.011
43. [43]
  (44) Jiang, L. L.; Liu,W. L.; Song,Y. F.; He, X.;Wang,Y.;Wu, H. L.; Yang,Y. Q. Acta Phys. -Chim. Sin. 2012, 28, 2953. [蒋礼林, 刘伟龙, 宋云飞, 何兴, 王阳, 吴红琳, 杨延强. 物理化学学报, 2012, 28, 2953.] doi: 10.3866/PKU.WHXB2012112
1. [1]
  Zhaoyue Lü , Zhehao Chen , Yi Ni , Duanbin Luo , Xianfeng Hong . Multi-Level Teaching Design and Practice Exploration of Raman Spectroscopy Experiment. University Chemistry, 2024, 39(11): 304-312. doi: 10.12461/PKU.DXHX202402047
2. [2]
  Jia Zhou . Constructing Potential Energy Surface of Water Molecule by Quantum Chemistry and Machine Learning: Introduction to a Comprehensive Computational Chemistry Experiment. University Chemistry, 2024, 39(3): 351-358. doi: 10.3866/PKU.DXHX202309060
3. [3]
  Wenliang Wang , Weina Wang , Sufan Wang , Tian Sheng , Tao Zhou , Nan Wei . “Schrödinger Equation – Approximate Models – Core Concepts – Simple Applications”: Constructing a Logical Framework and Knowledge Graph of Atom and Molecule Structures. University Chemistry, 2024, 39(8): 338-343. doi: 10.3866/PKU.DXHX202312084
4. [4]
  Dongju Zhang , Rongxiu Zhu . Construction of Ideological and Political Education in Quantum Chemistry Course: Several Teaching Cases to Reveal the Universal Connection of Things. University Chemistry, 2024, 39(7): 272-277. doi: 10.3866/PKU.DXHX202311032
5. [5]
  Xiumei LI , Yanju HUANG , Bo LIU , Yaru PAN . Syntheses, crystal structures, and quantum chemistry calculation of two Ni(Ⅱ) coordination polymers. Chinese Journal of Inorganic Chemistry, 2024, 40(10): 2031-2039. doi: 10.11862/CJIC.20240109
6. [6]
  Laiying Zhang , Yinghuan Wu , Yazi Yu , Yecheng Xu , Haojie Zhang , Weitai Wu . Innovation and Practice of Polymer Chemistry Experiment Teaching for Non-Polymer Major Students of Chemistry: Taking the Synthesis, Solution Property, Optical Performance and Application of Thermo-Sensitive Polymers as an Example. University Chemistry, 2024, 39(4): 213-220. doi: 10.3866/PKU.DXHX202310126
7. [7]
  Wenyan Dan , Weijie Li , Xiaogang Wang . The Technical Analysis of Visual Software ShelXle for Refinement of Small Molecular Crystal Structure. University Chemistry, 2024, 39(3): 63-69. doi: 10.3866/PKU.DXHX202302060
8. [8]
  Jizhou Liu , Chenbin Ai , Chenrui Hu , Bei Cheng , Jianjun Zhang . 六氯锡酸铵促进钙钛矿太阳能电池界面电子转移及其飞秒瞬态吸收光谱研究. Acta Physico-Chimica Sinica, 2024, 40(11): 2402006-. doi: 10.3866/PKU.WHXB202402006
9. [9]
  Jinfu Ma , Hui Lu , Jiandong Wu , Zhongli Zou . Teaching Design of Electrochemical Principles Course Based on “Cognitive Laws”: Kinetics of Electron Transfer Steps. University Chemistry, 2024, 39(3): 174-177. doi: 10.3866/PKU.DXHX202309052
10. [10]
  Rui Gao , Ying Zhou , Yifan Hu , Siyuan Chen , Shouhong Xu , Qianfu Luo , Wenqing Zhang . Design, Synthesis and Performance Experiment of Novel Photoswitchable Hybrid Tetraarylethenes. University Chemistry, 2024, 39(5): 125-133. doi: 10.3866/PKU.DXHX202310050
11. [11]
  Pingping Zhu , Yongjun Xie , Yuanping Yi , Yu Huang , Qiang Zhou , Shiyan Xiao , Haiyang Yang , Pingsheng He . Excavation and Extraction of Ideological and Political Elements for the Virtual Simulation Experiments at Molecular Level: Taking the Project “the Simulation and Computation of Conformation, Morphology and Dimensions of Polymer Chains” as an Example. University Chemistry, 2024, 39(2): 83-88. doi: 10.3866/PKU.DXHX202309063
12. [12]
  Jia Yao , Xiaogang Peng . Theory of Macroscopic Molecular Systems: Theoretical Framework of the Physical Chemistry Course in the Chemistry “101 Plan”. University Chemistry, 2024, 39(10): 27-37. doi: 10.12461/PKU.DXHX202408117
13. [13]
  Kai Yang , Gehua Bi , Yong Zhang , Delin Jin , Ziwei Xu , Qian Wang , Lingbao Xing . Comprehensive Polymer Chemistry Experiment Design: Preparation and Characterization of Rigid Polyurethane Foam Materials. University Chemistry, 2024, 39(4): 206-212. doi: 10.3866/PKU.DXHX202308045
14. [14]
  Rui Li , Jiayu Zhang , Anyang Li . Two Levels of Understanding of Chemical Bonds: a Case of the Bonding Model of Hypervalent Molecules. University Chemistry, 2024, 39(2): 392-398. doi: 10.3866/PKU.DXHX202308051
15. [15]
  Jiarong Feng , Yejie Duan , Chu Chu , Dezhen Xie , Qiu'e Cao , Peng Liu . Preparation and Application of a Streptomycin Molecularly Imprinted Electrochemical Sensor: A Suggested Comprehensive Analytical Chemical Experiment. University Chemistry, 2024, 39(8): 295-305. doi: 10.3866/PKU.DXHX202401016
16. [16]
  Hongyun Liu , Jiarun Li , Xinyi Li , Zhe Liu , Jiaxuan Li , Cong Xiao . Course Ideological and Political Design of a Comprehensive Chemistry Experiment: Constructing a Visual Molecular Logic System Based on Intelligent Hydrogel Film Electrodes. University Chemistry, 2024, 39(2): 227-233. doi: 10.3866/PKU.DXHX202309070
17. [17]
  Shuang Meng , Haixin Long , Zhou Zhou , Meizhu Rong . Inorganic Chemistry Curriculum Design and Implementation of Based on “Stepped-Task Driven + Multi-Dimensional Output” Model: A Case Study on Intermolecular Forces. University Chemistry, 2024, 39(3): 122-131. doi: 10.3866/PKU.DXHX202309008
18. [18]
  Lijun Huo , Mingcun Wang , Tianyi Zhao , Mingjie Liu . Exploration of Undergraduate and Graduate Integrated Teaching in Polymer Chemistry with Aerospace Characteristics. University Chemistry, 2024, 39(6): 103-111. doi: 10.3866/PKU.DXHX202312059
19. [19]
  Feng Zheng , Ruxun Yuan , Xiaogang Wang . “Research-Oriented” Comprehensive Experimental Design in Polymer Chemistry: the Case of Polyimide Aerogels. University Chemistry, 2024, 39(10): 210-218. doi: 10.12461/PKU.DXHX202404027
20. [20]
  Qi Wang , Yicong Gao , Feng Lu , Quli Fan . Preparation and Performance Characterization of the Second Near-Infrared Phototheranostic Probe: A New Design and Teaching Practice of Polymer Chemistry Comprehensive Experiment. University Chemistry, 2024, 39(11): 342-349. doi: 10.12461/PKU.DXHX202404141

Get Citation

PDF

XML

Metrics

PDF Downloads(470)
Abstract views(504)
HTML views(39)

通讯作者: 陈斌, bchen63@163.com

1.
沈阳化工大学材料科学与工程学院沈阳 110142